1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol

C13H25N5O — CID 80923421

IUPAC1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol
SMILESCCCc1c(NN)ncnc1N(CC)CC(C)(C)O
InChIInChI=1S/C13H25N5O/c1-5-7-10-11(17-14)15-9-16-12(10)18(6-2)8-13(3,4)19/h9,19H,5-8,14H2,1-4H3,(H,15,16,17)
InChIKeyWBCRPQQNZPWGES-UHFFFAOYSA-N
MW267.38 g/mol
LogP1.31
Rot. Bonds7

About 1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol

1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol (PubChem CID 80923421) has the molecular formula C13H25N5O and a molecular weight of 267.38 g/mol. Its IUPAC name is 1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol
PubChem CID80923421
Molecular FormulaC13H25N5O
Molecular Weight267.38 g/mol
Exact Mass267.21
IUPAC Name1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol
SMILESCCCc1c(NN)ncnc1N(CC)CC(C)(C)O
InChIInChI=1S/C13H25N5O/c1-5-7-10-11(17-14)15-9-16-12(10)18(6-2)8-13(3,4)19/h9,19H,5-8,14H2,1-4H3,(H,15,16,17)
InChIKeyWBCRPQQNZPWGES-UHFFFAOYSA-N
XLogP1.31
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-hydrazinyl-N,N-dimethyl-5-propylpyrimidin-4-amine
CID 80932720
N-ethyl-6-hydrazinyl-5-propyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
CID 80900573
2-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-methylamino]propan-1-ol
CID 104557148
6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine
CID 80906528
2-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-methylamino]-N,N-dimethylacetamide
CID 80894743
N-ethyl-6-hydrazinyl-N-(4-methylphenyl)-5-propylpyrimidin-4-amine
CID 80903906
1-[(6-amino-5-chloropyrimidin-4-yl)-ethylamino]-2-methylpropan-2-ol
CID 106812063
1-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)-ethylamino]-2-methylpropan-2-ol
CID 102762264
2-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-methylamino]-N-methylacetamide
CID 80894065
1-[ethyl-(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-2-methylpropan-2-ol
CID 80923163
1-[(6-amino-5-propan-2-ylpyrimidin-4-yl)-ethylamino]-2-methylpropan-2-ol
CID 80848620
3-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-(2-methylpropyl)amino]propanenitrile
CID 80900553

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol?
The IUPAC name of 1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol (CID 80923421) is 1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol is CCCc1c(NN)ncnc1N(CC)CC(C)(C)O.
What is the InChIKey of 1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol?
The InChIKey is WBCRPQQNZPWGES-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N5O/c1-5-7-10-11(17-14)15-9-16-12(10)18(6-2)8-13(3,4)19/h9,19H,5-8,14H2,1-4H3,(H,15,16,17).
What are the key properties of 1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol?
1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol has a molecular weight of 267.38 g/mol, XLogP of 1.31, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]-2-methylpropan-2-ol is sourced from PubChem (CID 80923421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).